Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride
TL;DR: Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride (CAS 78371-83-2) is a chemical compound with molecular formula C21H27Cl2N3O and molecular weight 407.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-(2-chloro-6-methylphenyl)-1-(2-pyrrolidin-1-ylethyl)urea;hydrochloride
Also Known As: Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride, 1-Benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)urea hydrochloride, 1-benzyl-3-(2-chloro-6-methylphenyl)-1-(2-pyrrolidin-1-ylethyl)urea hydrochloride, N-Benzyl-N'-(2-chloro-6-methylphenyl)-N-[2-(pyrrolidin-1-yl)ethyl]urea--hydrogen chloride (1/1), Urea, N'-(2-chloro-6-methylphenyl)-N-(phenylmethyl)-N-[2-(1-pyrrolidinyl)ethyl]-, monohydrochloride
| Molecular Formula | C21H27Cl2N3O |
|---|---|
| Molecular Weight | 407.15 g/mol |
| LogP | 5.20012 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.1531 |
| Heavy Atoms | 27 |
| Complexity | 713.2115 |
Chemical Identifiers
| CAS Number | 78371-83-2 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)Cl)NC(=O)N(CCN2CCCC2)CC3=CC=CC=C3.Cl |
Product Overview
Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride (CAS 78371-83-2), with molecular formula C21H27Cl2N3O and molecular weight 407.15 g/mol. IUPAC: 1-benzyl-3-(2-chloro-6-methylphenyl)-1-(2-pyrrolidin-1-ylethyl)urea;hydrochloride.
Chemical Property Profile of Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride
Property Insights of Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride
The XLogP value of 5.20012 indicates that Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.58 Ų, Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride?
The CAS number of Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride is 78371-83-2.
What is the molecular formula of Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride?
The molecular formula of Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride is C21H27Cl2N3O.
What is the molecular weight of Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride?
The molecular weight of Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride is 407.15 g/mol.
Where can I buy Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride?
You can request a quote for Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-benzyl-3-(6-chloro-o-tolyl)-1-(2-pyrrolidinylethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.